N-(piperidin-4-ylmethyl)-N-propylquinazolin-2-amine

C17H24N4 — CID 114789514

IUPACN-(piperidin-4-ylmethyl)-N-propylquinazolin-2-amine
SMILESCCCN(CC1CCNCC1)c1ncc2ccccc2n1
InChIInChI=1S/C17H24N4/c1-2-11-21(13-14-7-9-18-10-8-14)17-19-12-15-5-3-4-6-16(15)20-17/h3-6,12,14,18H,2,7-11,13H2,1H3
InChIKeyRKEJJHLCLLYLTB-UHFFFAOYSA-N
MW284.41 g/mol
LogP2.85
Rot. Bonds5

About N-(piperidin-4-ylmethyl)-N-propylquinazolin-2-amine

N-(piperidin-4-ylmethyl)-N-propylquinazolin-2-amine (PubChem CID 114789514) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is N-(piperidin-4-ylmethyl)-N-propylquinazolin-2-amine.

Molecular Properties

Compound NameN-(piperidin-4-ylmethyl)-N-propylquinazolin-2-amine
PubChem CID114789514
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC NameN-(piperidin-4-ylmethyl)-N-propylquinazolin-2-amine
SMILESCCCN(CC1CCNCC1)c1ncc2ccccc2n1
InChIInChI=1S/C17H24N4/c1-2-11-21(13-14-7-9-18-10-8-14)17-19-12-15-5-3-4-6-16(15)20-17/h3-6,12,14,18H,2,7-11,13H2,1H3
InChIKeyRKEJJHLCLLYLTB-UHFFFAOYSA-N
XLogP2.85
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-N-(piperidin-4-ylmethyl)-N-propylpyrimidin-2-amine
CID 79719331
5-nitro-N-(piperidin-4-ylmethyl)-N-propylpyrimidin-2-amine
CID 79719258
N-ethyl-N-(piperidin-2-ylmethyl)quinazolin-2-amine
CID 106641730
N'-propyl-N'-quinazolin-2-ylpropane-1,3-diamine
CID 114788667
N-ethyl-N-(piperidin-4-ylmethyl)-1,3-benzoxazol-2-amine
CID 79719885
4-ethoxy-6-methyl-N-(piperidin-4-ylmethyl)-N-propylpyrimidin-2-amine
CID 115973542
2-N-(cyclopropylmethyl)-2-N-propylpyrimidine-2,5-diamine
CID 61146606
N-methyl-N-(piperidin-4-ylmethyl)quinoxalin-2-amine
CID 71642441
N-ethyl-N-(piperidin-4-ylmethyl)phthalazin-1-amine
CID 79719670
5-bromo-N-(piperidin-4-ylmethyl)-N-propylpyridin-3-amine
CID 114194238
N-methyl-N-(piperidin-4-ylmethyl)quinoxalin-2-amine;hydrochloride
CID 71642440
N-(piperidin-4-ylmethyl)-N-propyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 79719326

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-4-ylmethyl)-N-propylquinazolin-2-amine?
The IUPAC name of N-(piperidin-4-ylmethyl)-N-propylquinazolin-2-amine (CID 114789514) is N-(piperidin-4-ylmethyl)-N-propylquinazolin-2-amine.
What is the SMILES notation for N-(piperidin-4-ylmethyl)-N-propylquinazolin-2-amine?
The canonical SMILES for N-(piperidin-4-ylmethyl)-N-propylquinazolin-2-amine is CCCN(CC1CCNCC1)c1ncc2ccccc2n1.
What is the InChIKey of N-(piperidin-4-ylmethyl)-N-propylquinazolin-2-amine?
The InChIKey is RKEJJHLCLLYLTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-2-11-21(13-14-7-9-18-10-8-14)17-19-12-15-5-3-4-6-16(15)20-17/h3-6,12,14,18H,2,7-11,13H2,1H3.
What are the key properties of N-(piperidin-4-ylmethyl)-N-propylquinazolin-2-amine?
N-(piperidin-4-ylmethyl)-N-propylquinazolin-2-amine has a molecular weight of 284.41 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-4-ylmethyl)-N-propylquinazolin-2-amine is sourced from PubChem (CID 114789514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).