2-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]cyclopropan-1-amine

C9H18N2 — CID 139357257

IUPAC2-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]cyclopropan-1-amine
SMILESC[C@H](NC1CC1CN)C1CC1
InChIInChI=1S/C9H18N2/c1-6(7-2-3-7)11-9-4-8(9)5-10/h6-9,11H,2-5,10H2,1H3/t6-,8?,9?/m0/s1
InChIKeyZOJPFGHSBWYSPY-GVWIPJJGSA-N
MW154.26 g/mol
LogP0.72
Rot. Bonds4

About 2-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]cyclopropan-1-amine

2-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]cyclopropan-1-amine (PubChem CID 139357257) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 2-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]cyclopropan-1-amine
PubChem CID139357257
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name2-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]cyclopropan-1-amine
SMILESC[C@H](NC1CC1CN)C1CC1
InChIInChI=1S/C9H18N2/c1-6(7-2-3-7)11-9-4-8(9)5-10/h6-9,11H,2-5,10H2,1H3/t6-,8?,9?/m0/s1
InChIKeyZOJPFGHSBWYSPY-GVWIPJJGSA-N
XLogP0.72
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]cyclopropan-1-amine?
The IUPAC name of 2-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]cyclopropan-1-amine (CID 139357257) is 2-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]cyclopropan-1-amine.
What is the SMILES notation for 2-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]cyclopropan-1-amine?
The canonical SMILES for 2-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]cyclopropan-1-amine is C[C@H](NC1CC1CN)C1CC1.
What is the InChIKey of 2-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]cyclopropan-1-amine?
The InChIKey is ZOJPFGHSBWYSPY-GVWIPJJGSA-N. The full InChI is InChI=1S/C9H18N2/c1-6(7-2-3-7)11-9-4-8(9)5-10/h6-9,11H,2-5,10H2,1H3/t6-,8?,9?/m0/s1.
What are the key properties of 2-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]cyclopropan-1-amine?
2-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]cyclopropan-1-amine has a molecular weight of 154.26 g/mol, XLogP of 0.72, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]cyclopropan-1-amine is sourced from PubChem (CID 139357257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).