N,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine

C21H32N6 — CID 126895716

IUPACN,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine
SMILESCN(C)c1ncnc2ccc(N3CCN(CC4CCCCN4C)CC3)cc12
InChIInChI=1S/C21H32N6/c1-24(2)21-19-14-17(7-8-20(19)22-16-23-21)27-12-10-26(11-13-27)15-18-6-4-5-9-25(18)3/h7-8,14,16,18H,4-6,9-13,15H2,1-3H3
InChIKeyTZYBBBKBPVIMLI-UHFFFAOYSA-N
MW368.53 g/mol
LogP2.30
Rot. Bonds4

About N,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine

N,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine (PubChem CID 126895716) has the molecular formula C21H32N6 and a molecular weight of 368.53 g/mol. Its IUPAC name is N,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine
PubChem CID126895716
Molecular FormulaC21H32N6
Molecular Weight368.53 g/mol
Exact Mass368.27
IUPAC NameN,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine
SMILESCN(C)c1ncnc2ccc(N3CCN(CC4CCCCN4C)CC3)cc12
InChIInChI=1S/C21H32N6/c1-24(2)21-19-14-17(7-8-20(19)22-16-23-21)27-12-10-26(11-13-27)15-18-6-4-5-9-25(18)3/h7-8,14,16,18H,4-6,9-13,15H2,1-3H3
InChIKeyTZYBBBKBPVIMLI-UHFFFAOYSA-N
XLogP2.30
TPSA38.74 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.53
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine with MolForge

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Related Compounds

6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]-4-pyrrolidin-1-ylquinazoline
CID 126896083
4-methoxy-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazoline
CID 126894689
1-[2-[[4-[4-(dimethylamino)quinazolin-6-yl]piperazin-1-yl]methyl]pyrrolidin-1-yl]ethanone
CID 126895881
7-[[4-[4-(dimethylamino)quinazolin-6-yl]piperazin-1-yl]methyl]azepan-2-one
CID 126895768
N,N-dimethyl-6-[4-[2-(1,4-oxazepan-4-yl)ethyl]piperazin-1-yl]quinazolin-4-amine
CID 126895886
4-methoxy-6-[4-[2-(1-methylpiperidin-2-yl)ethyl]piperazin-1-yl]quinazoline
CID 126894851
1-[2-[4-[4-(dimethylamino)quinazolin-6-yl]piperazin-1-yl]ethyl]azepan-2-one
CID 126895890
N,N-dimethyl-6-[4-[2-(4-methylpyrazol-1-yl)ethyl]piperazin-1-yl]quinazolin-4-amine
CID 126895875
6-[4-[(5-cyclopropyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]-N,N-dimethylquinazolin-4-amine
CID 126895865
N,N-dimethyl-6-[4-[(5-methyl-1,3-oxazol-4-yl)methyl]piperazin-1-yl]quinazolin-4-amine
CID 126895844
6-[4-(5,6-dihydro-4H-pyrrolo[2,1-e]pyrazol-2-ylmethyl)piperazin-1-yl]-N,N-dimethylquinazolin-4-amine
CID 126895778
4-[[4-[4-(dimethylamino)quinazolin-6-yl]piperazin-1-yl]methyl]-2-methylpyridazin-3-one
CID 126895783

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine?
The IUPAC name of N,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine (CID 126895716) is N,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine.
What is the SMILES notation for N,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine?
The canonical SMILES for N,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine is CN(C)c1ncnc2ccc(N3CCN(CC4CCCCN4C)CC3)cc12.
What is the InChIKey of N,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine?
The InChIKey is TZYBBBKBPVIMLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H32N6/c1-24(2)21-19-14-17(7-8-20(19)22-16-23-21)27-12-10-26(11-13-27)15-18-6-4-5-9-25(18)3/h7-8,14,16,18H,4-6,9-13,15H2,1-3H3.
What are the key properties of N,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine?
N,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine has a molecular weight of 368.53 g/mol, XLogP of 2.30, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]quinazolin-4-amine is sourced from PubChem (CID 126895716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).