1-[[(2-aminocyclopropyl)amino]methyl]cyclopropan-1-ol

C7H14N2O — CID 138658974

IUPAC1-[[(2-aminocyclopropyl)amino]methyl]cyclopropan-1-ol
SMILESNC1CC1NCC1(O)CC1
InChIInChI=1S/C7H14N2O/c8-5-3-6(5)9-4-7(10)1-2-7/h5-6,9-10H,1-4,8H2
InChIKeyHCBOUWNHMALFQG-UHFFFAOYSA-N
MW142.20 g/mol
LogP-0.80
Rot. Bonds3

About 1-[[(2-aminocyclopropyl)amino]methyl]cyclopropan-1-ol

1-[[(2-aminocyclopropyl)amino]methyl]cyclopropan-1-ol (PubChem CID 138658974) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 1-[[(2-aminocyclopropyl)amino]methyl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[[(2-aminocyclopropyl)amino]methyl]cyclopropan-1-ol
PubChem CID138658974
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name1-[[(2-aminocyclopropyl)amino]methyl]cyclopropan-1-ol
SMILESNC1CC1NCC1(O)CC1
InChIInChI=1S/C7H14N2O/c8-5-3-6(5)9-4-7(10)1-2-7/h5-6,9-10H,1-4,8H2
InChIKeyHCBOUWNHMALFQG-UHFFFAOYSA-N
XLogP-0.80
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 5-0.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[[(2-aminocyclopropyl)amino]methyl]cyclopropan-1-ol?
The IUPAC name of 1-[[(2-aminocyclopropyl)amino]methyl]cyclopropan-1-ol (CID 138658974) is 1-[[(2-aminocyclopropyl)amino]methyl]cyclopropan-1-ol.
What is the SMILES notation for 1-[[(2-aminocyclopropyl)amino]methyl]cyclopropan-1-ol?
The canonical SMILES for 1-[[(2-aminocyclopropyl)amino]methyl]cyclopropan-1-ol is NC1CC1NCC1(O)CC1.
What is the InChIKey of 1-[[(2-aminocyclopropyl)amino]methyl]cyclopropan-1-ol?
The InChIKey is HCBOUWNHMALFQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c8-5-3-6(5)9-4-7(10)1-2-7/h5-6,9-10H,1-4,8H2.
What are the key properties of 1-[[(2-aminocyclopropyl)amino]methyl]cyclopropan-1-ol?
1-[[(2-aminocyclopropyl)amino]methyl]cyclopropan-1-ol has a molecular weight of 142.20 g/mol, XLogP of -0.80, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(2-aminocyclopropyl)amino]methyl]cyclopropan-1-ol is sourced from PubChem (CID 138658974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).