3-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]-methylamino]-N-methylpropanamide

C14H22N4O2 — CID 106914165

IUPAC3-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]-methylamino]-N-methylpropanamide
SMILESCNC(=O)CCN(C)c1ccc(N)c(OCC2CC2)n1
InChIInChI=1S/C14H22N4O2/c1-16-13(19)7-8-18(2)12-6-5-11(15)14(17-12)20-9-10-3-4-10/h5-6,10H,3-4,7-9,15H2,1-2H3,(H,16,19)
InChIKeyRRUHKXUWIHWOKM-UHFFFAOYSA-N
MW278.36 g/mol
LogP1.02
Rot. Bonds7

About 3-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]-methylamino]-N-methylpropanamide

3-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]-methylamino]-N-methylpropanamide (PubChem CID 106914165) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 3-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]-methylamino]-N-methylpropanamide.

Molecular Properties

Compound Name3-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]-methylamino]-N-methylpropanamide
PubChem CID106914165
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name3-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]-methylamino]-N-methylpropanamide
SMILESCNC(=O)CCN(C)c1ccc(N)c(OCC2CC2)n1
InChIInChI=1S/C14H22N4O2/c1-16-13(19)7-8-18(2)12-6-5-11(15)14(17-12)20-9-10-3-4-10/h5-6,10H,3-4,7-9,15H2,1-2H3,(H,16,19)
InChIKeyRRUHKXUWIHWOKM-UHFFFAOYSA-N
XLogP1.02
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-(3-Amino-6-methoxypyridin-2-yl)piperazin-1-yl]ethan-1-one
CID 47003077
1-(6-Isobutoxy-2-pyridyl)piperazine
CID 13795744
1-[6-(Cyclopropylmethoxy)pyridin-2-yl]piperazine
CID 13795745
N-[2-Methoxy-6-(4-methylpiperazin-1-yl)pyridin-3-yl]prop-2-enamide
CID 137931039
2-Methoxy-6-(morpholin-4-yl)pyridin-3-amine
CID 12152132
N,N-dimethyl-2-[(6-piperazin-1-yl-2-pyridinyl)oxy]ethanamine
CID 13795747
N',N'-dimethyl-N-[6-(2-methylpropoxy)-2-pyridinyl]ethane-1,2-diamine
CID 13795751
1-[6-(2-Methylpropoxy)-2-pyridinyl]-1,4-diazepane
CID 13795752
N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]acetamide
CID 52845163
1-[1-(Cyclopropanecarbonyl)piperidin-4-yl]-3-(2-ethoxy-3-pyridinyl)urea
CID 53521017
N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]-4-methylpentanamide
CID 53565101
N-[2-(4-acetylpiperazin-1-yl)-6-methoxy-3-pyridinyl]oxolane-3-carboxamide
CID 53580310

Frequently Asked Questions

What is the IUPAC name of 3-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]-methylamino]-N-methylpropanamide?
The IUPAC name of 3-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]-methylamino]-N-methylpropanamide (CID 106914165) is 3-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]-methylamino]-N-methylpropanamide.
What is the SMILES notation for 3-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]-methylamino]-N-methylpropanamide?
The canonical SMILES for 3-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]-methylamino]-N-methylpropanamide is CNC(=O)CCN(C)c1ccc(N)c(OCC2CC2)n1.
What is the InChIKey of 3-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]-methylamino]-N-methylpropanamide?
The InChIKey is RRUHKXUWIHWOKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-16-13(19)7-8-18(2)12-6-5-11(15)14(17-12)20-9-10-3-4-10/h5-6,10H,3-4,7-9,15H2,1-2H3,(H,16,19).
What are the key properties of 3-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]-methylamino]-N-methylpropanamide?
3-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]-methylamino]-N-methylpropanamide has a molecular weight of 278.36 g/mol, XLogP of 1.02, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]-methylamino]-N-methylpropanamide is sourced from PubChem (CID 106914165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).