N-butan-2-yl-3-(2-cyclopropyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)propanamide

C16H26N4O — CID 64858757

IUPACN-butan-2-yl-3-(2-cyclopropyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)propanamide
SMILESCCC(C)NC(=O)CCn1c(C2CC2)nc2c1CCNC2
InChIInChI=1S/C16H26N4O/c1-3-11(2)18-15(21)7-9-20-14-6-8-17-10-13(14)19-16(20)12-4-5-12/h11-12,17H,3-10H2,1-2H3,(H,18,21)
InChIKeyUTXPIXJNQYRFCC-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.71
Rot. Bonds6

About N-butan-2-yl-3-(2-cyclopropyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)propanamide

N-butan-2-yl-3-(2-cyclopropyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)propanamide (PubChem CID 64858757) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N-butan-2-yl-3-(2-cyclopropyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)propanamide.

Molecular Properties

Compound NameN-butan-2-yl-3-(2-cyclopropyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)propanamide
PubChem CID64858757
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN-butan-2-yl-3-(2-cyclopropyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)propanamide
SMILESCCC(C)NC(=O)CCn1c(C2CC2)nc2c1CCNC2
InChIInChI=1S/C16H26N4O/c1-3-11(2)18-15(21)7-9-20-14-6-8-17-10-13(14)19-16(20)12-4-5-12/h11-12,17H,3-10H2,1-2H3,(H,18,21)
InChIKeyUTXPIXJNQYRFCC-UHFFFAOYSA-N
XLogP1.71
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-3-(2-cyclopropyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)propanamide?
The IUPAC name of N-butan-2-yl-3-(2-cyclopropyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)propanamide (CID 64858757) is N-butan-2-yl-3-(2-cyclopropyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)propanamide.
What is the SMILES notation for N-butan-2-yl-3-(2-cyclopropyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)propanamide?
The canonical SMILES for N-butan-2-yl-3-(2-cyclopropyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)propanamide is CCC(C)NC(=O)CCn1c(C2CC2)nc2c1CCNC2.
What is the InChIKey of N-butan-2-yl-3-(2-cyclopropyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)propanamide?
The InChIKey is UTXPIXJNQYRFCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-3-11(2)18-15(21)7-9-20-14-6-8-17-10-13(14)19-16(20)12-4-5-12/h11-12,17H,3-10H2,1-2H3,(H,18,21).
What are the key properties of N-butan-2-yl-3-(2-cyclopropyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)propanamide?
N-butan-2-yl-3-(2-cyclopropyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)propanamide has a molecular weight of 290.41 g/mol, XLogP of 1.71, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-3-(2-cyclopropyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)propanamide is sourced from PubChem (CID 64858757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).