2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

C17H29N3 — CID 64857941

IUPAC2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCCC(CC1CC1)n1c(C(C)(C)C)nc2c1CCNC2
InChIInChI=1S/C17H29N3/c1-5-13(10-12-6-7-12)20-15-8-9-18-11-14(15)19-16(20)17(2,3)4/h12-13,18H,5-11H2,1-4H3
InChIKeyNXOJWJSCBASDFO-UHFFFAOYSA-N
MW275.44 g/mol
LogP3.58
Rot. Bonds4

About 2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 64857941) has the molecular formula C17H29N3 and a molecular weight of 275.44 g/mol. Its IUPAC name is 2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID64857941
Molecular FormulaC17H29N3
Molecular Weight275.44 g/mol
Exact Mass275.24
IUPAC Name2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCCC(CC1CC1)n1c(C(C)(C)C)nc2c1CCNC2
InChIInChI=1S/C17H29N3/c1-5-13(10-12-6-7-12)20-15-8-9-18-11-14(15)19-16(20)17(2,3)4/h12-13,18H,5-11H2,1-4H3
InChIKeyNXOJWJSCBASDFO-UHFFFAOYSA-N
XLogP3.58
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine with MolForge

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Related Compounds

1-(1-cyclopropylbutan-2-yl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857939
2-tert-butyl-1-(3-methylpentan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64859335
1-(1-cyclopropylbutan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857940
2-tert-butyl-1-(cyclopropylmethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857299
2-tert-butyl-1-octan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858543
2-tert-butyl-1-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858284
2-cyclopropyl-1-(1-methoxybutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858571
2-tert-butyl-1-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64856921
2-tert-butyl-1-[(1-methylpiperidin-4-yl)methyl]-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64856415
1-(cyclopropylmethyl)-2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857297
1-hexan-3-yl-2-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857342
4-(2-tert-butyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)thiane 1,1-dioxide
CID 64856948

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 64857941) is 2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is CCC(CC1CC1)n1c(C(C)(C)C)nc2c1CCNC2.
What is the InChIKey of 2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is NXOJWJSCBASDFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3/c1-5-13(10-12-6-7-12)20-15-8-9-18-11-14(15)19-16(20)17(2,3)4/h12-13,18H,5-11H2,1-4H3.
What are the key properties of 2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 275.44 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-1-(1-cyclopropylbutan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 64857941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).