N-methylmethanamine;5-propoxy-4-pyridin-3-ylquinazolin-2-amine

C18H23N5O — CID 122510175

IUPACN-methylmethanamine;5-propoxy-4-pyridin-3-ylquinazolin-2-amine
SMILESCCCOc1cccc2nc(N)nc(-c3cccnc3)c12.CNC
InChIInChI=1S/C16H16N4O.C2H7N/c1-2-9-21-13-7-3-6-12-14(13)15(20-16(17)19-12)11-5-4-8-18-10-11;1-3-2/h3-8,10H,2,9H2,1H3,(H2,17,19,20);3H,1-2H3
InChIKeyKRZOYCCUTWYECO-UHFFFAOYSA-N
MW325.42 g/mol
LogP2.90
Rot. Bonds4

About N-methylmethanamine;5-propoxy-4-pyridin-3-ylquinazolin-2-amine

N-methylmethanamine;5-propoxy-4-pyridin-3-ylquinazolin-2-amine (PubChem CID 122510175) has the molecular formula C18H23N5O and a molecular weight of 325.42 g/mol. Its IUPAC name is N-methylmethanamine;5-propoxy-4-pyridin-3-ylquinazolin-2-amine.

Molecular Properties

Compound NameN-methylmethanamine;5-propoxy-4-pyridin-3-ylquinazolin-2-amine
PubChem CID122510175
Molecular FormulaC18H23N5O
Molecular Weight325.42 g/mol
Exact Mass325.19
IUPAC NameN-methylmethanamine;5-propoxy-4-pyridin-3-ylquinazolin-2-amine
SMILESCCCOc1cccc2nc(N)nc(-c3cccnc3)c12.CNC
InChIInChI=1S/C16H16N4O.C2H7N/c1-2-9-21-13-7-3-6-12-14(13)15(20-16(17)19-12)11-5-4-8-18-10-11;1-3-2/h3-8,10H,2,9H2,1H3,(H2,17,19,20);3H,1-2H3
InChIKeyKRZOYCCUTWYECO-UHFFFAOYSA-N
XLogP2.90
TPSA85.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.42
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-propoxy-6-pyridin-3-yloxyaniline
CID 113393434
5-(2-methoxyethoxy)quinazoline-2,4-diamine
CID 11637233
2-[(2-pyridin-3-yl-1,3-benzothiazol-4-yl)oxy]ethanamine
CID 82190401
6-propoxy-2-N-(pyridin-3-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 80773060
3-propoxy-4-pyridin-3-yl-1,2,5-thiadiazole;pyridine
CID 174364537
4-(2-propoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-6-amine
CID 104663115
ethyl 4-[(2-propoxybenzoyl)amino]-3-pyridin-3-yl-1H-pyrazole-5-carboxylate
CID 18329750
4-ethoxy-6-pyridin-3-ylpteridin-2-amine
CID 68775933
4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-amine
CID 14045777
methyl 2-amino-4-phenylquinazoline-5-carboxylate
CID 174554853
4-(2-methyl-3-pyridinyl)quinazoline-2,5-diamine
CID 163290769
4-N-butyl-5-prop-2-ynoxyquinazoline-2,4-diamine
CID 89215816

Frequently Asked Questions

What is the IUPAC name of N-methylmethanamine;5-propoxy-4-pyridin-3-ylquinazolin-2-amine?
The IUPAC name of N-methylmethanamine;5-propoxy-4-pyridin-3-ylquinazolin-2-amine (CID 122510175) is N-methylmethanamine;5-propoxy-4-pyridin-3-ylquinazolin-2-amine.
What is the SMILES notation for N-methylmethanamine;5-propoxy-4-pyridin-3-ylquinazolin-2-amine?
The canonical SMILES for N-methylmethanamine;5-propoxy-4-pyridin-3-ylquinazolin-2-amine is CCCOc1cccc2nc(N)nc(-c3cccnc3)c12.CNC.
What is the InChIKey of N-methylmethanamine;5-propoxy-4-pyridin-3-ylquinazolin-2-amine?
The InChIKey is KRZOYCCUTWYECO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O.C2H7N/c1-2-9-21-13-7-3-6-12-14(13)15(20-16(17)19-12)11-5-4-8-18-10-11;1-3-2/h3-8,10H,2,9H2,1H3,(H2,17,19,20);3H,1-2H3.
What are the key properties of N-methylmethanamine;5-propoxy-4-pyridin-3-ylquinazolin-2-amine?
N-methylmethanamine;5-propoxy-4-pyridin-3-ylquinazolin-2-amine has a molecular weight of 325.42 g/mol, XLogP of 2.90, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylmethanamine;5-propoxy-4-pyridin-3-ylquinazolin-2-amine is sourced from PubChem (CID 122510175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).