N-propan-2-yl-N-propylcyclopropanecarboximidamide

C10H20N2 — CID 63175891

IUPACN-propan-2-yl-N-propylcyclopropanecarboximidamide
SMILES[H]/N=C(\C1CC1)N(CCC)C(C)C
InChIInChI=1S/C10H20N2/c1-4-7-12(8(2)3)10(11)9-5-6-9/h8-9,11H,4-7H2,1-3H3/b11-10+
InChIKeyTUBSHUNDEPOKLK-ZHACJKMWSA-N
MW168.28 g/mol
LogP2.49
Rot. Bonds4

About N-propan-2-yl-N-propylcyclopropanecarboximidamide

N-propan-2-yl-N-propylcyclopropanecarboximidamide (PubChem CID 63175891) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is N-propan-2-yl-N-propylcyclopropanecarboximidamide.

Molecular Properties

Compound NameN-propan-2-yl-N-propylcyclopropanecarboximidamide
PubChem CID63175891
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC NameN-propan-2-yl-N-propylcyclopropanecarboximidamide
SMILES[H]/N=C(\C1CC1)N(CCC)C(C)C
InChIInChI=1S/C10H20N2/c1-4-7-12(8(2)3)10(11)9-5-6-9/h8-9,11H,4-7H2,1-3H3/b11-10+
InChIKeyTUBSHUNDEPOKLK-ZHACJKMWSA-N
XLogP2.49
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N-butan-2-yl-N-ethylcyclopentanecarboximidamide
CID 63176258
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclopentanecarboximidamide
CID 63177458
N-(2-methoxyethyl)-N-pentan-3-ylcyclohexanecarboximidamide
CID 63178188
N-ethyl-N-[(2R)-1-methoxypropan-2-yl]piperidine-4-carboximidamide
CID 166705160
N-methyl-N-(3-methylbutyl)cyclopentanecarboximidamide
CID 63177358
6-methyl-N-propan-2-yl-N-propylpiperidine-3-carboxamide
CID 43269800
N-(cyclopropylmethyl)-N-methylcyclopropanecarboximidamide
CID 63177015
N-methyl-N-(2-methylbutyl)cyclohexanecarboximidamide
CID 63175585
N-pentyl-N-propan-2-ylethanimidamide
CID 63173308
N-propan-2-yl-N-prop-1-en-2-ylpropan-1-amine
CID 134179329
2-cyclopentyl-1-propan-2-yl-1-propylguanidine
CID 62362054
N-cyclopropyl-N-(2-methylpropyl)cyclohexanecarboximidamide
CID 63176684

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-N-propylcyclopropanecarboximidamide?
The IUPAC name of N-propan-2-yl-N-propylcyclopropanecarboximidamide (CID 63175891) is N-propan-2-yl-N-propylcyclopropanecarboximidamide.
What is the SMILES notation for N-propan-2-yl-N-propylcyclopropanecarboximidamide?
The canonical SMILES for N-propan-2-yl-N-propylcyclopropanecarboximidamide is [H]/N=C(\C1CC1)N(CCC)C(C)C.
What is the InChIKey of N-propan-2-yl-N-propylcyclopropanecarboximidamide?
The InChIKey is TUBSHUNDEPOKLK-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H20N2/c1-4-7-12(8(2)3)10(11)9-5-6-9/h8-9,11H,4-7H2,1-3H3/b11-10+.
What are the key properties of N-propan-2-yl-N-propylcyclopropanecarboximidamide?
N-propan-2-yl-N-propylcyclopropanecarboximidamide has a molecular weight of 168.28 g/mol, XLogP of 2.49, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-N-propylcyclopropanecarboximidamide is sourced from PubChem (CID 63175891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).