1-[4-(cyclopropylmethyl)piperazin-1-yl]propan-2-amine

C11H23N3 — CID 61441180

IUPAC1-[4-(cyclopropylmethyl)piperazin-1-yl]propan-2-amine
SMILESCC(N)CN1CCN(CC2CC2)CC1
InChIInChI=1S/C11H23N3/c1-10(12)8-13-4-6-14(7-5-13)9-11-2-3-11/h10-11H,2-9,12H2,1H3
InChIKeyWCRCYOYEZQESAQ-UHFFFAOYSA-N
MW197.33 g/mol
LogP0.36
Rot. Bonds4

About 1-[4-(cyclopropylmethyl)piperazin-1-yl]propan-2-amine

1-[4-(cyclopropylmethyl)piperazin-1-yl]propan-2-amine (PubChem CID 61441180) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is 1-[4-(cyclopropylmethyl)piperazin-1-yl]propan-2-amine.

Molecular Properties

Compound Name1-[4-(cyclopropylmethyl)piperazin-1-yl]propan-2-amine
PubChem CID61441180
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC Name1-[4-(cyclopropylmethyl)piperazin-1-yl]propan-2-amine
SMILESCC(N)CN1CCN(CC2CC2)CC1
InChIInChI=1S/C11H23N3/c1-10(12)8-13-4-6-14(7-5-13)9-11-2-3-11/h10-11H,2-9,12H2,1H3
InChIKeyWCRCYOYEZQESAQ-UHFFFAOYSA-N
XLogP0.36
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclopropylmethyl)-4-(2-methylpropyl)piperazine
CID 59603480
1-[4-(cyclopropylmethyl)piperazin-1-yl]pentan-2-amine
CID 61442918
1-[3-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propan-2-amine
CID 83835140
[1-[(2S)-2-aminopropyl]piperidin-4-yl]methanol
CID 22689432
1-[(2R)-2-aminopropyl]piperidin-4-ol
CID 130939157
3-methyl-4-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]butan-2-amine
CID 113416111
2-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]pentan-1-amine
CID 65233062
4-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]butan-2-amine
CID 63009941
3-[4-(cyclopropylmethyl)piperazin-1-yl]-2-methyl-N-propylpropan-1-amine
CID 55069148
2-methyl-3-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-amine
CID 55141477
(2S)-1-(4-tert-butylpiperazin-1-yl)propan-2-amine
CID 94197824
2-[4-(cyclopropylmethyl)piperazin-1-yl]-1-(4-methoxyphenyl)ethanamine
CID 61441376

Frequently Asked Questions

What is the IUPAC name of 1-[4-(cyclopropylmethyl)piperazin-1-yl]propan-2-amine?
The IUPAC name of 1-[4-(cyclopropylmethyl)piperazin-1-yl]propan-2-amine (CID 61441180) is 1-[4-(cyclopropylmethyl)piperazin-1-yl]propan-2-amine.
What is the SMILES notation for 1-[4-(cyclopropylmethyl)piperazin-1-yl]propan-2-amine?
The canonical SMILES for 1-[4-(cyclopropylmethyl)piperazin-1-yl]propan-2-amine is CC(N)CN1CCN(CC2CC2)CC1.
What is the InChIKey of 1-[4-(cyclopropylmethyl)piperazin-1-yl]propan-2-amine?
The InChIKey is WCRCYOYEZQESAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-10(12)8-13-4-6-14(7-5-13)9-11-2-3-11/h10-11H,2-9,12H2,1H3.
What are the key properties of 1-[4-(cyclopropylmethyl)piperazin-1-yl]propan-2-amine?
1-[4-(cyclopropylmethyl)piperazin-1-yl]propan-2-amine has a molecular weight of 197.33 g/mol, XLogP of 0.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(cyclopropylmethyl)piperazin-1-yl]propan-2-amine is sourced from PubChem (CID 61441180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).