(Z)-1-[amino(pentyl)amino]pent-1-en-2-amine

C10H23N3 — CID 137455330

IUPAC(Z)-1-[amino(pentyl)amino]pent-1-en-2-amine
SMILESCCCCCN(N)/C=C(\N)CCC
InChIInChI=1S/C10H23N3/c1-3-5-6-8-13(12)9-10(11)7-4-2/h9H,3-8,11-12H2,1-2H3/b10-9-
InChIKeyQBZDDUAVMWEVLW-KTKRTIGZSA-N
MW185.31 g/mol
LogP1.95
Rot. Bonds7

About (Z)-1-[amino(pentyl)amino]pent-1-en-2-amine

(Z)-1-[amino(pentyl)amino]pent-1-en-2-amine (PubChem CID 137455330) has the molecular formula C10H23N3 and a molecular weight of 185.31 g/mol. Its IUPAC name is (Z)-1-[amino(pentyl)amino]pent-1-en-2-amine.

Molecular Properties

Compound Name(Z)-1-[amino(pentyl)amino]pent-1-en-2-amine
PubChem CID137455330
Molecular FormulaC10H23N3
Molecular Weight185.31 g/mol
Exact Mass185.19
IUPAC Name(Z)-1-[amino(pentyl)amino]pent-1-en-2-amine
SMILESCCCCCN(N)/C=C(\N)CCC
InChIInChI=1S/C10H23N3/c1-3-5-6-8-13(12)9-10(11)7-4-2/h9H,3-8,11-12H2,1-2H3/b10-9-
InChIKeyQBZDDUAVMWEVLW-KTKRTIGZSA-N
XLogP1.95
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3,4-Dibutyl-1,2-dihydrotriazole
CID 68028256
5-Butyl-3-hexyl-1,2-dihydrotriazole
CID 68028257
3,5-Dipentyl-1,2-dihydrotriazole
CID 68028258
3-Ethyl-5-pentyl-1,2-dihydrotriazole
CID 68028398
5-Ethyl-3-pentyl-1,2-dihydrotriazole
CID 68028399
5-Butyl-3-propyl-1,2-dihydrotriazole
CID 68028400
3-Ethyl-5-hexyl-1,2-dihydrotriazole
CID 69926514
4-Butyl-3-pentyl-1,2-dihydrotriazole
CID 69927014
4-Butyl-3-propyl-1,2-dihydrotriazole
CID 69927017
3-Butyl-5-propyl-1,2-dihydrotriazole
CID 69927037
3-Pentyl-4-propyl-1,2-dihydrotriazole
CID 69927267
3-Ethyl-5-heptyl-1,2-dihydrotriazole
CID 70230438

Frequently Asked Questions

What is the IUPAC name of (Z)-1-[amino(pentyl)amino]pent-1-en-2-amine?
The IUPAC name of (Z)-1-[amino(pentyl)amino]pent-1-en-2-amine (CID 137455330) is (Z)-1-[amino(pentyl)amino]pent-1-en-2-amine.
What is the SMILES notation for (Z)-1-[amino(pentyl)amino]pent-1-en-2-amine?
The canonical SMILES for (Z)-1-[amino(pentyl)amino]pent-1-en-2-amine is CCCCCN(N)/C=C(\N)CCC.
What is the InChIKey of (Z)-1-[amino(pentyl)amino]pent-1-en-2-amine?
The InChIKey is QBZDDUAVMWEVLW-KTKRTIGZSA-N. The full InChI is InChI=1S/C10H23N3/c1-3-5-6-8-13(12)9-10(11)7-4-2/h9H,3-8,11-12H2,1-2H3/b10-9-.
What are the key properties of (Z)-1-[amino(pentyl)amino]pent-1-en-2-amine?
(Z)-1-[amino(pentyl)amino]pent-1-en-2-amine has a molecular weight of 185.31 g/mol, XLogP of 1.95, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-[amino(pentyl)amino]pent-1-en-2-amine is sourced from PubChem (CID 137455330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).