6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide

C13H21ClN4O — CID 62161278

IUPAC6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide
SMILESCCN(CC)CC(C)NC(=O)c1nc(N)ccc1Cl
InChIInChI=1S/C13H21ClN4O/c1-4-18(5-2)8-9(3)16-13(19)12-10(14)6-7-11(15)17-12/h6-7,9H,4-5,8H2,1-3H3,(H2,15,17)(H,16,19)
InChIKeyYFVPRHALRZYJJI-UHFFFAOYSA-N
MW284.79 g/mol
LogP1.78
Rot. Bonds6

About 6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide

6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide (PubChem CID 62161278) has the molecular formula C13H21ClN4O and a molecular weight of 284.79 g/mol. Its IUPAC name is 6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide
PubChem CID62161278
Molecular FormulaC13H21ClN4O
Molecular Weight284.79 g/mol
Exact Mass284.14
IUPAC Name6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide
SMILESCCN(CC)CC(C)NC(=O)c1nc(N)ccc1Cl
InChIInChI=1S/C13H21ClN4O/c1-4-18(5-2)8-9(3)16-13(19)12-10(14)6-7-11(15)17-12/h6-7,9H,4-5,8H2,1-3H3,(H2,15,17)(H,16,19)
InChIKeyYFVPRHALRZYJJI-UHFFFAOYSA-N
XLogP1.78
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.79
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-3-chloro-N-(4-methylsulfanylbutan-2-yl)pyridine-2-carboxamide
CID 113478192
6-amino-3-chloro-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide
CID 55257710
6-amino-3-chloro-N-(4-phenylbutan-2-yl)pyridine-2-carboxamide
CID 62186305
6-amino-3-chloro-N-ethylpyridine-2-carboxamide
CID 62154853
6-amino-3-chloro-N-(2-methylpropyl)pyridine-2-carboxamide
CID 62156560
6-amino-3-chloro-N-[4-(furan-2-yl)butan-2-yl]pyridine-2-carboxamide
CID 62185489
6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide
CID 62153910
6-amino-3-chloro-N-methylpyridine-2-carboxamide
CID 62156050
3,6-dichloro-N-hexan-2-ylpyridine-2-carboxamide
CID 62200974
6-amino-N-butan-2-yl-3-chloro-N-ethylpyridine-2-carboxamide
CID 62154764
5-amino-2,3-dichloro-N-[1-(diethylamino)propan-2-yl]benzamide
CID 107184940
3,6-dichloro-N-[4-(dimethylamino)butan-2-yl]pyridine-2-carboxamide
CID 54968177

Frequently Asked Questions

What is the IUPAC name of 6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide?
The IUPAC name of 6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide (CID 62161278) is 6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide.
What is the SMILES notation for 6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide?
The canonical SMILES for 6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide is CCN(CC)CC(C)NC(=O)c1nc(N)ccc1Cl.
What is the InChIKey of 6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide?
The InChIKey is YFVPRHALRZYJJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21ClN4O/c1-4-18(5-2)8-9(3)16-13(19)12-10(14)6-7-11(15)17-12/h6-7,9H,4-5,8H2,1-3H3,(H2,15,17)(H,16,19).
What are the key properties of 6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide?
6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide has a molecular weight of 284.79 g/mol, XLogP of 1.78, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-chloro-N-[1-(diethylamino)propan-2-yl]pyridine-2-carboxamide is sourced from PubChem (CID 62161278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).