2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butan-1-ol

C15H32N2O — CID 103504030

IUPAC2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butan-1-ol
SMILESCC(C)NC(CO)CCN1CCC(C(C)C)CC1
InChIInChI=1S/C15H32N2O/c1-12(2)14-5-8-17(9-6-14)10-7-15(11-18)16-13(3)4/h12-16,18H,5-11H2,1-4H3
InChIKeyDWLMQXQIYQEONN-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.10
Rot. Bonds7

About 2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butan-1-ol

2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butan-1-ol (PubChem CID 103504030) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butan-1-ol.

Molecular Properties

Compound Name2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butan-1-ol
PubChem CID103504030
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butan-1-ol
SMILESCC(C)NC(CO)CCN1CCC(C(C)C)CC1
InChIInChI=1S/C15H32N2O/c1-12(2)14-5-8-17(9-6-14)10-7-15(11-18)16-13(3)4/h12-16,18H,5-11H2,1-4H3
InChIKeyDWLMQXQIYQEONN-UHFFFAOYSA-N
XLogP2.10
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(propan-2-ylamino)-4-(4-propan-2-ylazepan-1-yl)butan-1-ol
CID 64828249
4-(4-methoxypiperidin-1-yl)-2-(propan-2-ylamino)butan-1-ol
CID 64796609
4-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)butan-1-ol
CID 64826874
4-(1,1-dioxo-1,4-thiazepan-4-yl)-2-(propan-2-ylamino)butan-1-ol
CID 114083823
4-(4-phenylpiperazin-1-yl)-2-(propan-2-ylamino)butan-1-ol
CID 64791800
6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol
CID 103738002
2-(propan-2-ylamino)-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-1-ol
CID 102746406
4-[4-(dimethylamino)piperidin-1-yl]-2-(ethylamino)butan-1-ol
CID 64796209
2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butan-1-ol
CID 64826674
2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol
CID 114210339
4-(azocan-1-yl)-2-(methylamino)butan-1-ol
CID 64797115
1-cyclopropyl-3-(4-propan-2-ylpiperidin-1-yl)propan-1-amine
CID 103497340

Frequently Asked Questions

What is the IUPAC name of 2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butan-1-ol?
The IUPAC name of 2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butan-1-ol (CID 103504030) is 2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butan-1-ol.
What is the SMILES notation for 2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butan-1-ol?
The canonical SMILES for 2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butan-1-ol is CC(C)NC(CO)CCN1CCC(C(C)C)CC1.
What is the InChIKey of 2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butan-1-ol?
The InChIKey is DWLMQXQIYQEONN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-12(2)14-5-8-17(9-6-14)10-7-15(11-18)16-13(3)4/h12-16,18H,5-11H2,1-4H3.
What are the key properties of 2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butan-1-ol?
2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butan-1-ol has a molecular weight of 256.43 g/mol, XLogP of 2.10, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butan-1-ol is sourced from PubChem (CID 103504030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).