1-(imidazol-1-ylmethyl)-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]cyclopropane-1-carboxamide

C14H18N4OS — CID 125447141

IUPAC1-(imidazol-1-ylmethyl)-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]cyclopropane-1-carboxamide
SMILESCC[C@@H](NC(=O)C1(Cn2ccnc2)CC1)c1nccs1
InChIInChI=1S/C14H18N4OS/c1-2-11(12-16-6-8-20-12)17-13(19)14(3-4-14)9-18-7-5-15-10-18/h5-8,10-11H,2-4,9H2,1H3,(H,17,19)/t11-/m1/s1
InChIKeyUKXPESNRKOPFQM-LLVKDONJSA-N
MW290.39 g/mol
LogP2.39
Rot. Bonds6

About 1-(imidazol-1-ylmethyl)-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]cyclopropane-1-carboxamide

1-(imidazol-1-ylmethyl)-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]cyclopropane-1-carboxamide (PubChem CID 125447141) has the molecular formula C14H18N4OS and a molecular weight of 290.39 g/mol. Its IUPAC name is 1-(imidazol-1-ylmethyl)-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(imidazol-1-ylmethyl)-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]cyclopropane-1-carboxamide
PubChem CID125447141
Molecular FormulaC14H18N4OS
Molecular Weight290.39 g/mol
Exact Mass290.12
IUPAC Name1-(imidazol-1-ylmethyl)-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]cyclopropane-1-carboxamide
SMILESCC[C@@H](NC(=O)C1(Cn2ccnc2)CC1)c1nccs1
InChIInChI=1S/C14H18N4OS/c1-2-11(12-16-6-8-20-12)17-13(19)14(3-4-14)9-18-7-5-15-10-18/h5-8,10-11H,2-4,9H2,1H3,(H,17,19)/t11-/m1/s1
InChIKeyUKXPESNRKOPFQM-LLVKDONJSA-N
XLogP2.39
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(imidazol-1-ylmethyl)-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]cyclopropane-1-carboxamide with MolForge

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Related Compounds

1-(aminomethyl)-N-[1-(1,3-thiazol-2-yl)propyl]cyclohexane-1-carboxamide
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N-(3-hydroxy-3-methylbutan-2-yl)-1-(imidazol-1-ylmethyl)cyclopropane-1-carboxamide
CID 131920217
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CID 125443628
1-(imidazol-1-ylmethyl)-N-[(1-propan-2-ylimidazol-2-yl)methyl]cyclopropane-1-carboxamide
CID 131951634
2-(cyclopropylmethylamino)-N-[1-(1,3-thiazol-2-yl)propyl]acetamide;dihydrochloride
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2-methyl-N-[1-(1,3-thiazol-2-yl)propyl]pyrrolidine-3-carboxamide
CID 79384523
N-[(1R)-1-(1,3-thiazol-2-yl)propyl]-3-(1,2,4-triazol-1-yl)propanamide
CID 99628577
tert-butyl N-[1-(1,3-thiazol-2-yl)propyl]carbamate
CID 64688740
1-[2-(hydroxymethyl)-2-methylcyclopentyl]-3-[1-(1,3-thiazol-2-yl)propyl]urea
CID 111506596
2-(4-sulfanylphenyl)-N-[1-(1,3-thiazol-2-yl)propyl]acetamide
CID 107030803
2-cyclopentyl-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]acetamide
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Frequently Asked Questions

What is the IUPAC name of 1-(imidazol-1-ylmethyl)-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]cyclopropane-1-carboxamide?
The IUPAC name of 1-(imidazol-1-ylmethyl)-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]cyclopropane-1-carboxamide (CID 125447141) is 1-(imidazol-1-ylmethyl)-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(imidazol-1-ylmethyl)-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-(imidazol-1-ylmethyl)-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]cyclopropane-1-carboxamide is CC[C@@H](NC(=O)C1(Cn2ccnc2)CC1)c1nccs1.
What is the InChIKey of 1-(imidazol-1-ylmethyl)-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]cyclopropane-1-carboxamide?
The InChIKey is UKXPESNRKOPFQM-LLVKDONJSA-N. The full InChI is InChI=1S/C14H18N4OS/c1-2-11(12-16-6-8-20-12)17-13(19)14(3-4-14)9-18-7-5-15-10-18/h5-8,10-11H,2-4,9H2,1H3,(H,17,19)/t11-/m1/s1.
What are the key properties of 1-(imidazol-1-ylmethyl)-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]cyclopropane-1-carboxamide?
1-(imidazol-1-ylmethyl)-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]cyclopropane-1-carboxamide has a molecular weight of 290.39 g/mol, XLogP of 2.39, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(imidazol-1-ylmethyl)-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 125447141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).