N-[3-(dimethylamino)propyl]-N-ethyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide

C14H25N5O — CID 102992807

IUPACN-[3-(dimethylamino)propyl]-N-ethyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide
SMILESCCN(CCCN(C)C)C(=O)C1Cc2nc[nH]c2CN1
InChIInChI=1S/C14H25N5O/c1-4-19(7-5-6-18(2)3)14(20)12-8-11-13(9-15-12)17-10-16-11/h10,12,15H,4-9H2,1-3H3,(H,16,17)
InChIKeyTXLULVDBZYWMRA-UHFFFAOYSA-N
MW279.39 g/mol
LogP0.22
Rot. Bonds6

About N-[3-(dimethylamino)propyl]-N-ethyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide

N-[3-(dimethylamino)propyl]-N-ethyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide (PubChem CID 102992807) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-N-ethyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-N-ethyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide
PubChem CID102992807
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC NameN-[3-(dimethylamino)propyl]-N-ethyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide
SMILESCCN(CCCN(C)C)C(=O)C1Cc2nc[nH]c2CN1
InChIInChI=1S/C14H25N5O/c1-4-19(7-5-6-18(2)3)14(20)12-8-11-13(9-15-12)17-10-16-11/h10,12,15H,4-9H2,1-3H3,(H,16,17)
InChIKeyTXLULVDBZYWMRA-UHFFFAOYSA-N
XLogP0.22
TPSA64.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-N-ethyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide?
The IUPAC name of N-[3-(dimethylamino)propyl]-N-ethyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide (CID 102992807) is N-[3-(dimethylamino)propyl]-N-ethyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-N-ethyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]-N-ethyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide is CCN(CCCN(C)C)C(=O)C1Cc2nc[nH]c2CN1.
What is the InChIKey of N-[3-(dimethylamino)propyl]-N-ethyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide?
The InChIKey is TXLULVDBZYWMRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O/c1-4-19(7-5-6-18(2)3)14(20)12-8-11-13(9-15-12)17-10-16-11/h10,12,15H,4-9H2,1-3H3,(H,16,17).
What are the key properties of N-[3-(dimethylamino)propyl]-N-ethyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide?
N-[3-(dimethylamino)propyl]-N-ethyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide has a molecular weight of 279.39 g/mol, XLogP of 0.22, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-N-ethyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide is sourced from PubChem (CID 102992807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).