1-amino-N-[(5-amino-2-pyridinyl)methyl]cyclopropane-1-carboxamide

C10H14N4O — CID 67543179

IUPAC1-amino-N-[(5-amino-2-pyridinyl)methyl]cyclopropane-1-carboxamide
SMILESNc1ccc(CNC(=O)C2(N)CC2)nc1
InChIInChI=1S/C10H14N4O/c11-7-1-2-8(13-5-7)6-14-9(15)10(12)3-4-10/h1-2,5H,3-4,6,11-12H2,(H,14,15)
InChIKeyIGHCOGWKWSEPSU-UHFFFAOYSA-N
MW206.25 g/mol
LogP-0.23
Rot. Bonds3

About 1-amino-N-[(5-amino-2-pyridinyl)methyl]cyclopropane-1-carboxamide

1-amino-N-[(5-amino-2-pyridinyl)methyl]cyclopropane-1-carboxamide (PubChem CID 67543179) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is 1-amino-N-[(5-amino-2-pyridinyl)methyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[(5-amino-2-pyridinyl)methyl]cyclopropane-1-carboxamide
PubChem CID67543179
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Name1-amino-N-[(5-amino-2-pyridinyl)methyl]cyclopropane-1-carboxamide
SMILESNc1ccc(CNC(=O)C2(N)CC2)nc1
InChIInChI=1S/C10H14N4O/c11-7-1-2-8(13-5-7)6-14-9(15)10(12)3-4-10/h1-2,5H,3-4,6,11-12H2,(H,14,15)
InChIKeyIGHCOGWKWSEPSU-UHFFFAOYSA-N
XLogP-0.23
TPSA94.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 5-0.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[(5-amino-2-pyridinyl)methyl]cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-[(5-amino-2-pyridinyl)methyl]cyclopropane-1-carboxamide (CID 67543179) is 1-amino-N-[(5-amino-2-pyridinyl)methyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[(5-amino-2-pyridinyl)methyl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-[(5-amino-2-pyridinyl)methyl]cyclopropane-1-carboxamide is Nc1ccc(CNC(=O)C2(N)CC2)nc1.
What is the InChIKey of 1-amino-N-[(5-amino-2-pyridinyl)methyl]cyclopropane-1-carboxamide?
The InChIKey is IGHCOGWKWSEPSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c11-7-1-2-8(13-5-7)6-14-9(15)10(12)3-4-10/h1-2,5H,3-4,6,11-12H2,(H,14,15).
What are the key properties of 1-amino-N-[(5-amino-2-pyridinyl)methyl]cyclopropane-1-carboxamide?
1-amino-N-[(5-amino-2-pyridinyl)methyl]cyclopropane-1-carboxamide has a molecular weight of 206.25 g/mol, XLogP of -0.23, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[(5-amino-2-pyridinyl)methyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 67543179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).