N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methylcyclopropane-1-carboxamide

C10H15N5O — CID 71870587

IUPACN-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)NCc1nnnn1C1CC1
InChIInChI=1S/C10H15N5O/c1-6-4-8(6)10(16)11-5-9-12-13-14-15(9)7-2-3-7/h6-8H,2-5H2,1H3,(H,11,16)
InChIKeyCEGCPGYFGOKBMF-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.28
Rot. Bonds4

About N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methylcyclopropane-1-carboxamide

N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methylcyclopropane-1-carboxamide (PubChem CID 71870587) has the molecular formula C10H15N5O and a molecular weight of 221.26 g/mol. Its IUPAC name is N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methylcyclopropane-1-carboxamide
PubChem CID71870587
Molecular FormulaC10H15N5O
Molecular Weight221.26 g/mol
Exact Mass221.13
IUPAC NameN-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)NCc1nnnn1C1CC1
InChIInChI=1S/C10H15N5O/c1-6-4-8(6)10(16)11-5-9-12-13-14-15(9)7-2-3-7/h6-8H,2-5H2,1H3,(H,11,16)
InChIKeyCEGCPGYFGOKBMF-UHFFFAOYSA-N
XLogP0.28
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-((1-cyclohexyl-1H-tetrazol-5-yl)methyl)isobutyramide
CID 41568266
2-methyl-N-[1-(1-methyltetrazol-5-yl)ethyl]hexanamide
CID 121521258
N-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]-2-ethylbutanamide
CID 124741455
(2S)-2-(5-tert-butyltetrazol-1-yl)-N-(2-cyclopropyl-2-oxoethyl)propanamide
CID 164641190
(Rs)-4-methyl-2-(5-methyl-1-tetrazolyl)pentan-amide
CID 12967961
13-Propan-2-yl-1,8,12,15,16,17-hexazabicyclo[12.3.0]heptadeca-14,16-dien-7-one
CID 135034638
N-((1-cyclohexyl-1H-tetrazol-5-yl)methyl)butyramide
CID 41568264
N-((1-cyclohexyl-1H-tetrazol-5-yl)methyl)-3-methylbutanamide
CID 41568273
N-((1-cyclohexyl-1H-tetrazol-5-yl)methyl)cyclopropanecarboxamide
CID 44007516
N-[1-[(1-cyclopropyltetrazol-5-yl)methyl]piperidin-4-yl]-2,2-dimethylpropanamide
CID 44753578
N-[(1-cyclopentyltetrazol-5-yl)methyl]acetamide
CID 30295247
N-[(1-cyclopentyltetrazol-5-yl)methyl]propanamide
CID 30295250

Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methylcyclopropane-1-carboxamide?
The IUPAC name of N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methylcyclopropane-1-carboxamide (CID 71870587) is N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methylcyclopropane-1-carboxamide is CC1CC1C(=O)NCc1nnnn1C1CC1.
What is the InChIKey of N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methylcyclopropane-1-carboxamide?
The InChIKey is CEGCPGYFGOKBMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O/c1-6-4-8(6)10(16)11-5-9-12-13-14-15(9)7-2-3-7/h6-8H,2-5H2,1H3,(H,11,16).
What are the key properties of N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methylcyclopropane-1-carboxamide?
N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methylcyclopropane-1-carboxamide has a molecular weight of 221.26 g/mol, XLogP of 0.28, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 71870587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).